Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.54 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.48 |
| ▸ | DAO | P14920 | 2/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1004267 | 0.85 | LOXL2 (0.64) | LOXL2CYP2A6KCNJ1KCNH2TSHR | |
| SCHEMBL31231842 | 0.85 | TSHR (0.58) | LOXL2CYP2A6KCNJ1KCNH2TSHR | |
| SCHEMBL10569888 | 0.80 | TSHR (0.68) | LOXL2CYP2A6KCNJ1KCNH2TSHR | |
| SCHEMBL9640908 | 0.80 | TSHR (0.62) | LOXL2CYP2A6KCNJ1KCNH2TSHR | |
| SCHEMBL200142 | 0.80 | LOXL2 (0.58) | LOXL2CYP2A6KCNJ1KCNH2TSHR | |
| SCHEMBL9860834 | 0.79 | GFER (0.42) | CYP2A6MAOAMAOBALDH1A1CA2 | |
| SCHEMBL10452241 | 0.78 | LOXL2 (0.56) | LOXL2CYP2A6KCNJ1KCNH2TSHR | |
| SCHEMBL16582463 | 0.78 | TSHR (0.71) | LOXL2CYP2A6KCNJ1KCNH2TSHR | |
| SCHEMBL16582531 | 0.78 | TSHR (0.71) | LOXL2CYP2A6KCNJ1KCNH2TSHR | |
| SCHEMBL10569117 | 0.78 | TSHR (0.71) | LOXL2CYP2A6KCNJ1KCNH2TSHR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109232175-A | A kind of preparation method of chloroethyl substituted aromatic compound | 四川理工学院 | 2019-01-18 | — | — | CN | disclosed |
| EP-0912586-B1 | FUNCTIONALIZED FERROCENYLDIPHOSPHINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE | SYNGENTA PARTICIPATIONS AG (CH) | 2002-01-16 | — | — | EP | disclosed |
| US-6169192-B1 | LIGANDS FOR TRANSITION METAL COMPLEXES SUITABLE FOR ENANTIOSELECTIVE HYDROGENATION OF ORGANIC DOUBLE OR TRIPLE BONDS | NOVARTIS AG (CH) | 2001-01-02 | — | — | US | disclosed |
| EP-0912586-A1 | FUNCTIONALIZED FERROCENYLDIPHOSPHINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE | Novartis AG (CH) | 1999-05-06 | — | — | EP | disclosed |
| WO-1998001457-A1 | FUNCTIONALIZED FERROCENYLDIPHOSPHINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE | NOVARTIS AG (CH) | 1998-01-15 | — | — | WO | disclosed |